SCHEMBL19862537

SCHEMBL19862537

Cc1cnc(C2CCCC2)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
ADORA1 P30542 4/20 0.34
ADORA3 P0DMS8 4/20 0.33
ADORA2A P29274 4/20 0.33
HPGDS O60760 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
GFER P55789 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
ADORA2B P29275 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6633135 0.98 NPC1 (0.42) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL25690928 0.96 NPC1 (0.37) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL14488002 0.91
SCHEMBL8489672 0.84 HPGDS (0.48) HPGDS
Hydrochloric Acid SCHEMBL22468947 0.82 HPGDS (0.47) HPGDS
SCHEMBL22860618 0.81 PARP1 (0.44) HPGDS
SCHEMBL10061828 0.76 CDC7 (0.41) NPC1RAB9AKDM4EALDH1A1ADORA3
SCHEMBL25690929 0.76 PDE1B (0.34) MAPK1
SCHEMBL28643814 0.76 TLR8 (0.37) HPGDSPOLBTYK2
SCHEMBL9977183 0.75 KDM4E (0.34) NPC1RAB9AKDM4EALDH1A1HPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023088493-A1 FURO-PYRIDONE COMPOUND AND USE THEREOF 中国科学院广州生物医药与健康研究院 2023-05-25 WO disclosed
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-02-15 US disclosed
US-20110112100-A1 Hepatitis C Virus Inhibitors PFIZER INC. 2011-05-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180044343-A1 BICYCLIC IMIDAZOLO DERIVATIVE PDE3A, PDE2A, PDE5A NPC1 3237/4885RAB9A 1310/4885KDM4E 2496/4885
US-20110112100-A1 Hepatitis C Virus Inhibitors HAVCR2, SLC10A1, HCCS NPC1 36/4885RAB9A 2253/4885KDM4E 3835/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.